==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 13-DEC-06 2O99 . COMPND 2 MOLECULE: ACETATE OPERON REPRESSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR V.V.LUNIN,A.EZERSKY,E.EVDOKIMOVA,M.KUDRITSKA,A.SAVCHENKO . 717 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31043.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 505 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 146 20.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 45 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 248 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 3 0 1 1 2 0 0 4 0 0 1 3 0 1 0 2 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 3 4 2 3 3 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A G 0 0 51 0, 0.0 2,-0.3 0, 0.0 131,-0.1 0.000 360.0 360.0 360.0 142.4 10.6 -1.7 -55.0 2 2 A H - 0 0 46 232,-0.0 2,-0.5 28,-0.0 176,-0.3 -0.993 360.0-149.8-147.3 122.0 7.0 -3.1 -54.8 3 3 A X + 0 0 3 -2,-0.3 233,-2.3 233,-0.3 2,-0.3 -0.844 18.4 177.9-100.6 129.5 5.5 -5.4 -52.2 4 4 A S > - 0 0 7 -2,-0.5 4,-2.8 231,-0.2 5,-0.2 -0.748 45.3-105.5-115.4 168.9 2.7 -7.7 -53.3 5 5 A R H > S+ 0 0 55 218,-0.4 4,-2.8 -2,-0.3 5,-0.1 0.915 123.8 55.4 -61.8 -40.3 0.8 -10.4 -51.2 6 6 A N H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 109.5 45.0 -56.3 -48.8 2.8 -13.0 -53.1 7 7 A L H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.903 111.5 52.4 -64.9 -44.7 6.1 -11.3 -52.1 8 8 A L H X S+ 0 0 13 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.920 109.7 50.9 -53.5 -42.4 4.9 -10.9 -48.5 9 9 A A H < S+ 0 0 56 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.897 109.1 50.5 -60.0 -43.8 4.2 -14.6 -48.5 10 10 A I H < S+ 0 0 69 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.911 118.5 36.7 -63.5 -46.2 7.7 -15.5 -49.8 11 11 A V H >X S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 4,-1.4 0.575 87.7 98.9 -86.2 -11.3 9.4 -13.4 -47.2 12 12 A H H 3X S+ 0 0 30 -4,-1.5 4,-2.6 1,-0.2 5,-0.2 0.842 75.9 60.4 -39.8 -50.6 7.0 -14.2 -44.3 13 13 A P H 3> S+ 0 0 65 0, 0.0 4,-3.2 0, 0.0 -1,-0.2 0.814 102.3 54.1 -51.2 -35.7 9.4 -17.0 -42.8 14 14 A I H <> S+ 0 0 21 -3,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.921 111.2 43.8 -67.2 -46.4 12.1 -14.4 -42.3 15 15 A L H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.924 116.2 47.8 -62.0 -44.1 9.7 -12.2 -40.3 16 16 A R H X S+ 0 0 90 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.907 111.3 49.8 -65.2 -47.0 8.4 -15.2 -38.4 17 17 A N H X S+ 0 0 92 -4,-3.2 4,-2.3 -5,-0.2 -1,-0.2 0.896 112.2 49.8 -56.6 -43.7 12.0 -16.5 -37.7 18 18 A L H X S+ 0 0 7 -4,-2.4 4,-2.7 2,-0.2 6,-0.3 0.876 109.3 49.7 -62.4 -42.5 12.9 -12.9 -36.4 19 19 A X H X S+ 0 0 18 -4,-2.3 4,-2.2 1,-0.2 5,-0.4 0.919 113.4 49.4 -61.3 -44.5 9.8 -12.7 -34.1 20 20 A E H < S+ 0 0 115 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.937 114.8 41.4 -59.4 -47.4 10.9 -16.1 -32.8 21 21 A E H < S+ 0 0 122 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.954 124.5 36.0 -71.1 -48.2 14.5 -15.2 -32.2 22 22 A S H < S- 0 0 4 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.749 94.9-139.4 -75.4 -25.4 13.8 -11.8 -30.7 23 23 A G < + 0 0 20 -4,-2.2 2,-0.3 -5,-0.3 25,-0.3 0.646 69.5 102.4 70.4 15.3 10.5 -12.8 -28.9 24 24 A E S S- 0 0 4 -5,-0.4 -1,-0.3 -6,-0.3 -2,-0.2 -0.856 83.8 -79.8-126.5 161.1 9.0 -9.5 -30.0 25 25 A T E -A 144 0A 0 119,-0.9 119,-2.5 -2,-0.3 2,-0.4 -0.329 41.6-150.0 -58.2 133.3 6.6 -8.3 -32.7 26 26 A V E -AB 143 44A 0 18,-2.7 18,-2.5 117,-0.2 2,-0.4 -0.944 13.1-169.8-111.9 132.6 8.1 -7.8 -36.1 27 27 A N E -AB 142 43A 0 115,-2.7 115,-2.4 -2,-0.4 2,-0.5 -0.930 14.8-155.0-121.3 144.5 6.8 -5.3 -38.6 28 28 A X E -AB 141 42A 0 14,-2.9 13,-3.2 -2,-0.4 14,-1.6 -0.996 21.9-177.2-116.2 125.8 7.4 -4.6 -42.3 29 29 A A E -AB 140 40A 1 111,-2.7 111,-2.2 -2,-0.5 2,-0.3 -0.863 14.3-148.8-119.2 147.2 6.8 -1.0 -43.3 30 30 A V E -AB 139 39A 17 9,-2.7 9,-2.8 -2,-0.3 2,-0.6 -0.875 21.9-118.2-113.7 153.2 7.0 0.7 -46.7 31 31 A L E - B 0 38A 22 107,-2.3 2,-0.9 -2,-0.3 7,-0.2 -0.793 17.3-140.0 -90.1 120.0 8.0 4.3 -47.4 32 32 A D E >> - B 0 37A 21 5,-2.7 4,-1.6 -2,-0.6 5,-0.8 -0.742 14.9-162.6 -74.3 110.4 5.3 6.4 -49.1 33 33 A Q T 45S+ 0 0 119 -2,-0.9 -1,-0.2 1,-0.2 -2,-0.0 0.747 83.9 47.7 -68.7 -30.5 7.4 8.4 -51.5 34 34 A S T 45S+ 0 0 107 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.931 126.3 24.6 -73.0 -50.3 4.7 11.1 -52.1 35 35 A D T 45S- 0 0 88 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.448 99.0-127.6-103.0 -2.1 3.8 11.8 -48.5 36 36 A H T <5 + 0 0 94 -4,-1.6 2,-0.3 1,-0.2 26,-0.2 0.967 59.9 134.2 49.7 64.8 7.0 10.7 -46.9 37 37 A E E < -B 32 0A 38 -5,-0.8 -5,-2.7 24,-0.1 2,-0.6 -0.911 56.8-122.1-130.5 162.1 5.5 8.4 -44.3 38 38 A A E -BC 31 60A 0 22,-0.8 22,-2.9 -2,-0.3 2,-0.5 -0.930 29.5-167.0-108.9 111.3 6.2 4.7 -43.0 39 39 A I E -BC 30 59A 0 -9,-2.8 -9,-2.7 -2,-0.6 2,-0.3 -0.845 19.6-130.1-107.2 121.1 3.2 2.4 -43.5 40 40 A I E +B 29 0A 0 18,-2.8 17,-2.4 -2,-0.5 -11,-0.3 -0.532 32.9 167.3 -67.8 122.7 3.0 -1.0 -41.8 41 41 A I E + 0 0 2 -13,-3.2 2,-0.3 1,-0.4 -12,-0.2 0.492 63.0 17.0-117.8 -11.6 2.1 -3.6 -44.5 42 42 A D E -B 28 0A 6 -14,-1.6 -14,-2.9 2,-0.0 -1,-0.4 -0.975 60.7-179.3-153.4 164.6 2.9 -6.8 -42.6 43 43 A Q E -B 27 0A 2 -2,-0.3 2,-0.5 -16,-0.3 -16,-0.2 -0.979 19.5-160.4-163.1 137.2 3.4 -8.0 -39.1 44 44 A V E -B 26 0A 4 -18,-2.5 -18,-2.7 -2,-0.3 2,-0.2 -0.956 27.2-150.3-119.6 107.3 4.2 -11.1 -37.1 45 45 A Q - 0 0 41 -2,-0.5 -20,-0.1 -20,-0.2 2,-0.1 -0.478 11.2-125.6 -72.1 145.1 3.1 -10.6 -33.5 46 46 A C - 0 0 5 6,-0.3 -22,-0.1 -2,-0.2 -21,-0.1 -0.335 23.6-117.3 -75.9 174.4 4.9 -12.3 -30.6 47 47 A T S S+ 0 0 129 -2,-0.1 -1,-0.1 -23,-0.0 4,-0.1 0.467 70.7 125.2 -98.2 1.0 2.7 -14.4 -28.1 48 48 A H - 0 0 71 -25,-0.3 546,-0.2 1,-0.1 -2,-0.1 -0.236 67.8-127.4 -58.9 147.2 3.5 -12.3 -25.0 49 49 A L S S+ 0 0 33 1,-0.1 545,-3.4 544,-0.1 2,-0.5 0.919 104.2 46.0 -56.6 -45.7 0.5 -10.9 -23.2 50 50 A X E S+F 593 0B 5 543,-0.2 2,-0.3 615,-0.2 543,-0.2 -0.874 85.0 129.1 -97.8 121.5 2.0 -7.5 -23.4 51 51 A R E -F 592 0B 33 541,-2.0 541,-2.0 -2,-0.5 2,-0.4 -0.979 62.8 -79.6-164.0 172.3 3.4 -6.7 -26.8 52 52 A X E +F 591 0B 0 92,-0.6 -6,-0.3 -2,-0.3 539,-0.2 -0.694 45.6 168.6 -84.4 130.4 3.5 -4.1 -29.7 53 53 A S + 0 0 1 537,-2.7 538,-0.1 -2,-0.4 -1,-0.1 -0.300 1.8 166.6-142.4 53.6 0.3 -4.5 -31.8 54 54 A A - 0 0 4 1,-0.1 2,-0.1 4,-0.0 3,-0.1 -0.353 43.4-103.5 -63.0 151.5 -0.0 -1.6 -34.2 55 55 A P > - 0 0 48 0, 0.0 3,-2.0 0, 0.0 -15,-0.2 -0.444 34.7 -97.4 -70.0 153.0 -2.7 -2.3 -36.9 56 56 A I T 3 S+ 0 0 2 127,-2.8 127,-0.3 1,-0.3 -15,-0.2 -0.529 119.7 33.4 -60.5 135.1 -1.8 -3.2 -40.5 57 57 A G T 3 S+ 0 0 5 -17,-2.4 -1,-0.3 1,-0.3 -16,-0.1 0.259 91.7 139.7 92.0 -4.8 -2.0 0.1 -42.4 58 58 A G < - 0 0 15 -3,-2.0 -18,-2.8 -19,-0.1 2,-0.4 -0.260 48.9-129.0 -64.5 151.7 -0.7 1.9 -39.3 59 59 A K E -C 39 0A 47 -20,-0.2 -20,-0.2 -3,-0.1 -1,-0.1 -0.912 10.7-154.3-112.8 135.7 1.8 4.7 -39.8 60 60 A L E -C 38 0A 9 -22,-2.9 -22,-0.8 -2,-0.4 5,-0.2 -0.890 32.7-109.1-105.5 122.2 5.1 5.0 -37.9 61 61 A P - 0 0 18 0, 0.0 3,-0.5 0, 0.0 4,-0.4 -0.136 19.1-132.6 -57.7 141.7 6.4 8.6 -37.6 62 62 A X S S+ 0 0 32 1,-0.2 3,-0.3 -26,-0.2 10,-0.3 0.896 102.8 33.1 -58.6 -46.1 9.5 9.5 -39.7 63 63 A H S S+ 0 0 23 1,-0.2 31,-0.4 5,-0.1 -1,-0.2 0.513 125.0 43.6 -86.4 -5.4 11.5 11.3 -37.0 64 64 A A S S+ 0 0 0 -3,-0.5 2,-0.3 29,-0.1 -1,-0.2 0.038 97.2 62.6-142.2 23.5 10.3 9.2 -34.1 65 65 A S S > S- 0 0 1 -4,-0.4 4,-2.0 -3,-0.3 5,-0.2 -0.939 77.5-111.7-142.4 167.5 10.2 5.5 -34.9 66 66 A G H > S+ 0 0 0 -2,-0.3 4,-2.2 2,-0.2 61,-0.2 0.972 118.9 41.9 -62.4 -53.1 12.6 2.6 -35.8 67 67 A A H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.961 115.0 51.1 -62.8 -46.6 11.2 2.3 -39.3 68 68 A G H >> S+ 0 0 0 -7,-0.4 4,-2.5 1,-0.2 3,-0.6 0.945 113.7 42.7 -52.3 -60.2 10.9 6.0 -39.9 69 69 A K H 3X S+ 0 0 0 -4,-2.0 4,-2.7 -8,-0.3 -1,-0.2 0.792 107.3 60.9 -63.2 -31.1 14.5 6.8 -38.8 70 70 A A H 3< S+ 0 0 2 -4,-2.2 4,-0.4 -5,-0.2 -1,-0.2 0.913 109.7 43.5 -58.2 -40.8 15.8 3.8 -40.8 71 71 A F H X< S+ 0 0 6 -4,-2.0 3,-1.7 -3,-0.6 4,-0.4 0.950 113.2 50.3 -66.0 -52.2 14.3 5.5 -43.9 72 72 A L H >< S+ 0 0 23 -4,-2.5 3,-2.3 -10,-0.3 -2,-0.2 0.905 102.0 61.9 -51.9 -45.4 15.7 9.0 -42.9 73 73 A A T 3< S+ 0 0 1 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.680 97.5 60.3 -53.8 -22.6 19.2 7.5 -42.3 74 74 A Q T < S+ 0 0 79 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.581 91.4 88.6 -81.4 -16.2 19.2 6.5 -46.1 75 75 A L S < S- 0 0 42 -3,-2.3 5,-0.0 -4,-0.4 -3,-0.0 -0.518 86.6-101.6 -83.6 153.9 18.9 10.2 -47.2 76 76 A S > - 0 0 50 -2,-0.2 4,-2.3 1,-0.1 5,-0.3 -0.295 33.6-111.3 -65.7 154.9 21.7 12.6 -47.8 77 77 A E H > S+ 0 0 152 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.873 121.1 53.0 -58.6 -35.8 22.5 15.1 -45.1 78 78 A E H > S+ 0 0 158 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.933 107.6 51.2 -62.0 -46.5 21.1 17.9 -47.4 79 79 A Q H 4 S+ 0 0 101 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.853 114.7 41.7 -59.2 -41.3 17.9 16.0 -47.9 80 80 A V H < S+ 0 0 33 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.889 111.6 56.7 -72.0 -38.6 17.3 15.6 -44.2 81 81 A T H < 0 0 84 -4,-2.5 -2,-0.2 -5,-0.3 -3,-0.2 0.845 360.0 360.0 -62.8 -34.0 18.5 19.3 -43.6 82 82 A K < 0 0 192 -4,-2.3 -1,-0.2 -5,-0.1 -4,-0.0 -0.649 360.0 360.0 -81.8 360.0 15.7 20.4 -46.1 83 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 84 87 A K 0 0 221 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -38.0 8.7 21.0 -40.9 85 88 A G - 0 0 79 0, 0.0 2,-0.5 0, 0.0 10,-0.0 -0.802 360.0-136.0 -83.0 136.5 7.9 21.2 -37.2 86 89 A L - 0 0 54 -2,-0.4 2,-0.2 9,-0.3 9,-0.0 -0.843 14.7-121.6-101.6 128.8 8.4 17.7 -35.6 87 90 A H - 0 0 119 -2,-0.5 2,-0.9 1,-0.1 3,-0.2 -0.470 15.8-136.5 -70.3 137.2 5.7 16.4 -33.2 88 91 A A + 0 0 59 1,-0.2 31,-0.1 -2,-0.2 3,-0.1 -0.859 27.2 172.1 -93.3 100.1 6.9 15.5 -29.7 89 92 A Y S S+ 0 0 99 -2,-0.9 2,-0.3 29,-0.5 32,-0.2 0.825 72.8 1.6 -68.2 -39.2 5.2 12.2 -28.8 90 93 A T S > S- 0 0 15 28,-0.4 3,-0.7 -3,-0.2 -1,-0.1 -0.878 81.7 -95.9-139.2 172.6 7.4 12.0 -25.6 91 94 A H T 3 S+ 0 0 162 -2,-0.3 27,-0.1 1,-0.2 -1,-0.0 0.796 126.4 54.2 -58.8 -26.4 10.0 13.9 -23.7 92 95 A A T 3 S+ 0 0 33 25,-0.5 -1,-0.2 2,-0.1 26,-0.2 0.676 77.1 119.0 -87.8 -13.8 12.5 11.6 -25.6 93 96 A T S < S- 0 0 10 -3,-0.7 2,-1.2 24,-0.3 3,-0.2 -0.270 71.0-123.3 -53.2 123.0 11.2 12.5 -29.1 94 97 A L + 0 0 37 -31,-0.4 -1,-0.1 1,-0.2 -2,-0.1 -0.595 50.8 152.2 -71.0 95.7 14.1 14.1 -31.1 95 98 A V + 0 0 68 -2,-1.2 -9,-0.3 -31,-0.0 -1,-0.2 0.660 46.9 87.6-102.3 -17.7 12.6 17.4 -32.1 96 99 A S S > S- 0 0 38 -3,-0.2 4,-2.6 1,-0.1 3,-0.2 -0.721 73.3-144.1 -84.1 119.2 15.9 19.3 -32.3 97 100 A P H > S+ 0 0 76 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.815 99.9 56.2 -57.0 -35.9 17.4 18.9 -35.8 98 101 A V H > S+ 0 0 101 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.954 111.4 43.6 -55.4 -51.7 21.0 18.8 -34.4 99 102 A H H > S+ 0 0 117 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.906 114.0 51.1 -63.2 -40.6 20.0 15.8 -32.2 100 103 A L H X S+ 0 0 13 -4,-2.6 4,-2.2 1,-0.2 3,-0.3 0.954 109.3 49.0 -64.6 -48.9 18.1 14.1 -35.0 101 104 A K H X S+ 0 0 68 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.817 108.8 53.2 -60.8 -35.6 20.9 14.3 -37.5 102 105 A E H X S+ 0 0 122 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.858 108.4 50.6 -68.8 -37.6 23.4 12.9 -34.9 103 106 A D H X S+ 0 0 30 -4,-1.8 4,-2.2 -3,-0.3 -2,-0.2 0.886 110.8 48.5 -64.3 -42.3 21.1 9.9 -34.3 104 107 A L H X S+ 0 0 3 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.818 108.3 55.6 -65.8 -32.8 20.9 9.3 -38.1 105 108 A A H X S+ 0 0 24 -4,-1.6 4,-1.7 -5,-0.2 -2,-0.2 0.949 110.8 43.9 -61.8 -49.1 24.7 9.6 -38.3 106 109 A Q H X S+ 0 0 90 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.853 108.0 59.2 -67.2 -36.3 25.0 6.8 -35.7 107 110 A T H X>S+ 0 0 7 -4,-2.2 4,-1.7 2,-0.2 5,-0.7 0.909 105.5 48.9 -56.9 -50.1 22.3 4.7 -37.4 108 111 A R H <5S+ 0 0 109 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.894 114.6 46.3 -58.0 -41.8 24.4 4.7 -40.6 109 112 A K H <5S+ 0 0 151 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.927 116.8 40.7 -70.8 -43.4 27.4 3.6 -38.6 110 113 A R H <5S- 0 0 71 -4,-3.2 -1,-0.2 2,-0.2 -2,-0.2 0.650 106.3-123.2 -79.9 -14.6 25.8 0.8 -36.4 111 114 A G T <5S+ 0 0 39 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.2 0.470 80.8 62.9 91.9 3.8 23.7 -0.5 -39.4 112 115 A Y S S- 0 0 22 3,-0.4 3,-2.0 469,-0.0 -1,-0.4 -0.993 80.6-101.7-145.9 139.5 5.6 5.9 -27.1 121 124 A L T 3 S+ 0 0 85 -2,-0.4 470,-0.2 1,-0.3 3,-0.1 -0.317 109.9 16.4 -58.8 138.9 6.7 5.6 -23.5 122 125 A G T 3 S+ 0 0 4 1,-0.2 25,-2.6 570,-0.1 2,-0.5 0.306 102.7 112.3 78.0 -0.7 7.9 2.1 -22.7 123 126 A L E < - 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